RefChem:476939
TL;DR: RefChem:476939 (CAS 59641-46-2) is a chemical compound with molecular formula C26H20ClN7O11S3 and molecular weight 737.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[[4-chloro-6-(3-sulfoanilino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)diazenyl]naphthalene-2-sulfonic acid
Also Known As: 2-Naphthalenesulfonic acid, 7-((4-chloro-6-((3-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methoxy-2-sulfophenyl)azo)-, 2-Naphthalenesulfonic acid, 7-((4-chloro-6-((3-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-(2-(4-methoxy-2-sulfophenyl)diazenyl)-, 2-Naphthalenesulfonic acid, 7-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)azo]-, 7-((4-Chloro-6-((3-sulphophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methoxy-2-sulphophenyl)azo)naphthalene-2-sulphonic acid, 2-Naphthalenesulfonic acid, 7-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[2-(4-methoxy-2-sulfophenyl)diazenyl]-
| Molecular Formula | C26H20ClN7O11S3 |
|---|---|
| Molecular Weight | 737.01 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 305.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 10 |
| Exact Mass | 737.00714 |
| Heavy Atoms | 48 |
| Complexity | 1460.0 |
Chemical Identifiers
| CAS Number | 59641-46-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)N=NC2=C(C=C3C=C(C=CC3=C2O)NC4=NC(=NC(=N4)NC5=CC(=CC=C5)S(=O)(=O)O)Cl)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | SYUMGWWSOBXIMP-UHFFFAOYSA-N |
Product Overview
RefChem:476939 (CAS 59641-46-2), with molecular formula C26H20ClN7O11S3 and molecular weight 737.01 g/mol. IUPAC: 7-[[4-chloro-6-(3-sulfoanilino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)diazenyl]naphthalene-2-sulfonic acid.
Chemical Property Profile of RefChem:476939
Property Insights of RefChem:476939
The XLogP value of 3.6 indicates that RefChem:476939 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 305.0 Ų indicates high polarity, suggesting RefChem:476939 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:476939 has 6 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:476939?
The CAS number of RefChem:476939 is 59641-46-2.
What is the molecular formula of RefChem:476939?
The molecular formula of RefChem:476939 is C26H20ClN7O11S3.
What is the molecular weight of RefChem:476939?
The molecular weight of RefChem:476939 is 737.01 g/mol.
Where can I buy RefChem:476939?
You can request a quote for RefChem:476939 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:476939?
Yes, KEHONG BIO provides custom synthesis services for RefChem:476939 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.